Benzaldehyde dimethyl acetal

• CAS: 1125-88-8
• Catalog Number: ACM1125888
• Category: Acetalization Reagents
• Molecular Weight: 152.19
• Molecular Formula: C9H12O2
• Synonyms: 6-Ethyl-2,4-dioxo-3-propionyl-3,4-dihydro-2H-pyran-5-carboxylic acid
• IUPAC Name: Dimethoxymethylbenzene
• Canonical SMILES: COC(C1=CC=CC=C1)OC
• InChI: InChI=1S/C9H12O2/c1-10-9(11-2)8-6-4-3-5-7-8/h3-7,9H,1-2H3
• InChI Key: HEVMDQBCAHEHDY-UHFFFAOYSA-N
• Boiling Point: 87-89 °C
• Melting Point: 87-89 °C
• Flash Point: 157 °F
• Density: 1.014 g/mL at 25 °C(lit.)
• Solubility: Insoluble in water; soluble in organic solvents, oils
• Appearance: Colorless liquid
• Assay: 0.99
• EC Number: 214-413-0
• Exact Mass: 152.083729621
• Hazard Statements: Xn
• MDL Number: MFCD00008491
• Monoisotopic Mass: 152.083729621
• Odor: Sweet, floral-almond odor
• Packaging: 1 kg
• Physical State: Liquid
• Refractive Index: n20/D 1.493(lit.)
• RIDADR: NONH for all modes of transport
• Safety Description: 23-24/25-37/39-36-26
• Stability: Stable under normal temperatures and pressures.
• Storage Conditions: Inert atmosphere,2-8 °C
• Supplemental Hazard Statements: H227-H319-H302
• Symbol: GHS07
• Topological Polar Surface Area: 18.5 Ų

Custom Q&A

What is the molecular formula of Benzaldehyde dimethyl acetal?

The molecular formula of Benzaldehyde dimethyl acetal is C9H12O2.

What is the molecular weight of Benzaldehyde dimethyl acetal?

The molecular weight of Benzaldehyde dimethyl acetal is 152.19 g/mol.

What is the IUPAC Name of Benzaldehyde dimethyl acetal?

The IUPAC Name of Benzaldehyde dimethyl acetal is dimethoxymethylbenzene.

What is the InChIKey of Benzaldehyde dimethyl acetal?

The InChIKey of Benzaldehyde dimethyl acetal is HEVMDQBCAHEHDY-UHFFFAOYSA-N.

Does Benzaldehyde dimethyl acetal have any hydrogen bond donor?

No, Benzaldehyde dimethyl acetal does not have any hydrogen bond donor.

How many hydrogen bond acceptors are present in Benzaldehyde dimethyl acetal?

Benzaldehyde dimethyl acetal has 2 hydrogen bond acceptors.

What is the topological polar surface area of Benzaldehyde dimethyl acetal?

The topological polar surface area of Benzaldehyde dimethyl acetal is 18.5Ų.

How many rotatable bonds does Benzaldehyde dimethyl acetal have?

Benzaldehyde dimethyl acetal has 3 rotatable bonds.

What is the complexity of Benzaldehyde dimethyl acetal?

The complexity of Benzaldehyde dimethyl acetal is 93.7.

Does Benzaldehyde dimethyl acetal have any defined atom stereocenter count?

No, Benzaldehyde dimethyl acetal does not have any defined atom stereocenter count.